7NTD
The structure of the SBP TarP_Csal in complex with ferulate
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-06-27 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 1 |
| Unit cell lengths | 49.860, 52.280, 68.530 |
| Unit cell angles | 101.68, 98.59, 104.90 |
Refinement procedure
| Resolution | 47.124 - 1.750 |
| Rwork | 0.191 |
| R-free | 0.25170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7nsw |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.458 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.890 | 1.800 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.080 | 0.687 |
| Rpim | 0.073 | 0.620 |
| Number of reflections | 62516 | 4572 |
| <I/σ(I)> | 6.2 | |
| Completeness [%] | 96.8 | 95.4 |
| Redundancy | 2 | 2 |
| CC(1/2) | 0.988 | 0.470 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 290 | 0.2 M MgCl2, 0.1 M Tris pH 8.5 and 20 % (w/v) PEG 8000 |
